COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  N   UNL     1      -4.477  -0.044  -0.042  1.00  0.00           N  
HETATM    2  C   UNL     1       6.647  -0.237   0.320  1.00  0.00           C  
HETATM    3  N   UNL     1      -5.773   1.880   0.356  1.00  0.00           N  
HETATM    4  C   UNL     1       5.694   1.237  -1.309  1.00  0.00           C  
HETATM    5  C   UNL     1       6.960   1.542  -1.773  1.00  0.00           C  
HETATM    6  C   UNL     1       8.069   0.954  -1.195  1.00  0.00           C  
HETATM    7  N   UNL     1      -6.901  -1.492  -0.247  1.00  0.00           N  
HETATM    8  O   UNL     1     -10.464   0.236   0.173  1.00  0.00           O  
HETATM    9  C   UNL     1      -9.369  -0.281   0.047  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.133   0.506   0.161  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.128   1.877   0.419  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.915   2.527   0.509  1.00  0.00           C  
HETATM   13  N   UNL     1      -9.239  -1.605  -0.204  1.00  0.00           N  
HETATM   14  C   UNL     1      -8.009  -2.165  -0.343  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.900  -0.162   0.002  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.715   0.584   0.111  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.319   0.552  -0.428  1.00  0.00           C  
HETATM   18  N   UNL     1      -4.206  -1.400   0.183  1.00  0.00           N  
HETATM   19  C   UNL     1      -2.938  -1.610  -0.058  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.356  -0.398  -0.445  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.910  -0.187  -0.816  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.110   0.175   0.437  1.00  0.00           C  
HETATM   23  N   UNL     1       1.299   0.380   0.075  1.00  0.00           N  
HETATM   24  C   UNL     1       2.051   0.956   1.197  1.00  0.00           C  
HETATM   25  C   UNL     1       3.474   1.291   0.740  1.00  0.00           C  
HETATM   26  C   UNL     1       1.911  -0.872  -0.387  1.00  0.00           C  
HETATM   27  C   UNL     1       3.329  -0.592  -0.891  1.00  0.00           C  
HETATM   28  C   UNL     1       4.158   0.014   0.245  1.00  0.00           C  
HETATM   29  C   UNL     1       5.538   0.347  -0.262  1.00  0.00           C  
HETATM   30  C   UNL     1       7.913   0.068  -0.145  1.00  0.00           C  
HETATM   31  C   UNL     1       9.123  -0.564   0.493  1.00  0.00           C  
HETATM   32  F   UNL     1       8.855  -0.827   1.841  1.00  0.00           F  
HETATM   33  F   UNL     1       9.425  -1.761  -0.164  1.00  0.00           F  
HETATM   34  F   UNL     1      10.212   0.309   0.396  1.00  0.00           F  
HETATM   35  H   UNL     1       6.526  -0.929   1.140  1.00  0.00           H  
HETATM   36  H   UNL     1       4.828   1.697  -1.760  1.00  0.00           H  
HETATM   37  H   UNL     1       7.082   2.240  -2.588  1.00  0.00           H  
HETATM   38  H   UNL     1       9.058   1.192  -1.557  1.00  0.00           H  
HETATM   39  H   UNL     1      -9.055   2.418   0.545  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.898   3.588   0.708  1.00  0.00           H  
HETATM   41  H   UNL     1     -10.031  -2.160  -0.286  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.948  -3.224  -0.543  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.191   1.595  -0.678  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.427  -2.558   0.027  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.510  -1.103  -1.251  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.836   0.623  -1.542  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.511   1.090   0.872  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.185  -0.635   1.162  1.00  0.00           H  
HETATM   49  H   UNL     1       1.556   1.866   1.537  1.00  0.00           H  
HETATM   50  H   UNL     1       2.092   0.237   2.015  1.00  0.00           H  
HETATM   51  H   UNL     1       3.434   2.020  -0.068  1.00  0.00           H  
HETATM   52  H   UNL     1       4.036   1.704   1.577  1.00  0.00           H  
HETATM   53  H   UNL     1       1.953  -1.583   0.438  1.00  0.00           H  
HETATM   54  H   UNL     1       1.314  -1.291  -1.197  1.00  0.00           H  
HETATM   55  H   UNL     1       3.789  -1.525  -1.219  1.00  0.00           H  
HETATM   56  H   UNL     1       3.288   0.108  -1.725  1.00  0.00           H  
HETATM   57  H   UNL     1       4.233  -0.701   1.064  1.00  0.00           H  
CONECT    1   16   18   17                                            
CONECT    2   29   29   30   35                                       
CONECT    3   12   16   16                                            
CONECT    4   29    5    5   36                                       
CONECT    5    4    4    6   37                                       
CONECT    6   30   30    5   38                                       
CONECT    7   15   14   14                                            
CONECT    8    9    9                                                 
CONECT    9    8    8   10   13                                       
CONECT   10   11    9   15   15                                       
CONECT   11   12   12   10   39                                       
CONECT   12   11   11    3   40                                       
CONECT   13    9   14   41                                            
CONECT   14   13    7    7   42                                       
CONECT   15   10   10   16    7                                       
CONECT   16    3    3   15    1                                       
CONECT   17    1   20   20   43                                       
CONECT   18    1   19   19                                            
CONECT   19   18   18   20   44                                       
CONECT   20   17   17   19   21                                       
CONECT   21   20   22   45   46                                       
CONECT   22   21   23   47   48                                       
CONECT   23   22   26   24                                            
CONECT   24   23   25   49   50                                       
CONECT   25   24   28   51   52                                       
CONECT   26   23   27   53   54                                       
CONECT   27   26   28   55   56                                       
CONECT   28   27   25   29   57                                       
CONECT   29   28    2    2    4                                       
CONECT   30    2   31    6    6                                       
CONECT   31   32   30   33   34                                       
CONECT   32   31                                                      
CONECT   33   31                                                      
CONECT   34   31                                                      
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   28                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
